N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide

C19H23N3O2 — CID 42068095

IUPACN-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide
SMILESCC(C)(C)NC(=O)NC(=O)CNc1ccccc1-c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-19(2,3)22-18(24)21-17(23)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-12,20H,13H2,1-3H3,(H2,21,22,23,24)
InChIKeyFHKQGMKMWUEJJY-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.39
Rot. Bonds4

About N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide

N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide (PubChem CID 42068095) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide.

Molecular Properties

Compound NameN-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide
PubChem CID42068095
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide
SMILESCC(C)(C)NC(=O)NC(=O)CNc1ccccc1-c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-19(2,3)22-18(24)21-17(23)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-12,20H,13H2,1-3H3,(H2,21,22,23,24)
InChIKeyFHKQGMKMWUEJJY-UHFFFAOYSA-N
XLogP3.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-phenylanilino)-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 41397473
2-(2-phenylanilino)-N-(propylcarbamoyl)acetamide
CID 42068134
2-(2-acetylanilino)-N-(tert-butylcarbamoyl)acetamide
CID 26526540
N-(tert-butylcarbamoyl)-2-(3-chloro-2-methylanilino)acetamide
CID 26507318
methyl 2-(2-phenylanilino)acetate
CID 28569437
2-[2-(azepan-1-yl)anilino]-N-(tert-butylcarbamoyl)acetamide
CID 36588357
N-(tert-butylcarbamoyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 26509429
N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide
CID 28569421
2-(2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 9080600
N-(tert-butylcarbamoyl)-2-[2-[(3S,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]acetamide
CID 36864784
N-(tert-butylcarbamoyl)-2-(2-chloro-4-methylanilino)acetamide
CID 26507654
2-(2-bromoanilino)-N-tert-butylacetamide
CID 28581046

Frequently Asked Questions

What is the IUPAC name of N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide?
The IUPAC name of N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide (CID 42068095) is N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide.
What is the SMILES notation for N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide?
The canonical SMILES for N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide is CC(C)(C)NC(=O)NC(=O)CNc1ccccc1-c1ccccc1.
What is the InChIKey of N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide?
The InChIKey is FHKQGMKMWUEJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-19(2,3)22-18(24)21-17(23)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-12,20H,13H2,1-3H3,(H2,21,22,23,24).
What are the key properties of N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide?
N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.39, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tert-butylcarbamoyl)-2-(2-phenylanilino)acetamide is sourced from PubChem (CID 42068095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).